SCHEMBL2223599

SCHEMBL2223599

Cc1cc(-c2nc3cnc(Oc4cc(F)ccc4F)nc3o2)cc(C)c1[O]

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
S1PR1 P21453 1/20 0.47
APP P05067 9/20 0.35
CEPT1 Q9Y6K0 2/20 0.33
MAOB P27338 1/20 0.33
CETP P11597 1/20 0.33
SCN9A Q15858 1/20 0.33
BRD4 O60885 2/20 0.32
LMNA P02545 1/20 0.32
MAPT P10636 1/20 0.32
RXFP1 Q9HBX9 1/20 0.32
TP53 P04637 1/20 0.32
THRB P10828 1/20 0.32
MAPK14 Q16539 1/20 0.31

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL2223699 0.93 S1PR1 (0.45) S1PR1APPCEPT1MAOBCETP
SCHEMBL2223727 0.92 S1PR1 (0.47) S1PR1APPCETPLMNAMAPT
SCHEMBL2222292 0.92 S1PR1 (0.44) S1PR1BRD4MAPK14
SCHEMBL2222186 0.92 S1PR1 (0.48) S1PR1APPCEPT1LMNAMAPT
SCHEMBL2222588 0.91 S1PR1 (0.52) S1PR1APPCEPT1MAOBCETP
SCHEMBL2223206 0.90 S1PR1 (0.47) S1PR1APPCEPT1MAOBSCN9A
SCHEMBL2224913 0.88 S1PR1 (0.47) S1PR1APPCEPT1CETPMAPT
SCHEMBL2225559 0.88 S1PR1 (0.49) S1PR1APPCEPT1MAOBSCN9A
SCHEMBL2224142 0.86 S1PR1 (0.51) S1PR1APPCETPLMNAMAPT
SCHEMBL2222899 0.86 S1PR1 (0.51) S1PR1APPCETPSCN9ALMNA

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2523962-A1 CARBOXYLIC ACID DERIVATIVES HAVING A 2,5-SUBSTITUTED OXAZOLOPYRIMIDINE RING SANOFI (FR) 2012-11-21 EP claimed
WO-2011086079-A1 CARBOXYLIC ACID DERIVATIVES HAVING A 2,5-SUBSTITUTED OXAZOLOPYRIMIDINE RING SANOFI-AVENTIS (FR) 2011-07-21 WO claimed
EP-2523962-A1 CARBOXYLIC ACID DERIVATIVES HAVING A 2,5-SUBSTITUTED OXAZOLOPYRIMIDINE RING SANOFI (FR) 2012-11-21 EP disclosed
WO-2011086079-A1 CARBOXYLIC ACID DERIVATIVES HAVING A 2,5-SUBSTITUTED OXAZOLOPYRIMIDINE RING SANOFI-AVENTIS (FR) 2011-07-21 WO disclosed